[Wien] lapw0_mpi hangs

[Markus Kaukonen]

Dear Wien2k,

I have compiled parallel wien2k in a following environment: (intel11
and openmpi1.4.3)
 Currently Loaded Modulefiles:
  1) gcc/4.4.3                      5) openmpi/1.4.3
  2) binutils/2.20                  6) PrgEnv-intel/11.1.064
  3) intel/11.1.064
  4) acml/ifort/4.3.0

Problem is that parallel version of lapw0 (that is lapw0_mpi) produces
about 92% of the output compared to the serial version
(files case.output0000 and case.output0)
and thereafter nothing happens (though CPU time runs and processes are alive).
Serial lapw0 runs in 2 minutes and a 4 prosessor parallel job does not
finish in one hour.
The first MISSING line in the parallel output file is:
 SELECTED FOURIERCOEFF. OF V-XC


I'm happy to provide more info, but really don't know howto proceed here.
Files I get are:
-rw-r--r-- 1 mkaukone markau     1041 Jan 31 12:45 :log
-rw------- 1 mkaukone markau     1164 Jan 31 12:45 lapw0.def
-rw------- 1 mkaukone markau      336 Jan 31 12:45 :parallel_lapw0
-rw------- 1 mkaukone markau       15 Jan 31 12:45 lapw0.error
-rw------- 1 mkaukone markau        0 Jan 31 12:45 gra44half.vspup
-rw------- 1 mkaukone markau      397 Jan 31 12:45 gra44half.dayfile
-rw------- 1 mkaukone markau        0 Jan 31 12:45 gra44half.vspdn
-rw------- 1 mkaukone markau        0 Jan 31 12:45 gra44half.vnsup
-rw------- 1 mkaukone markau        0 Jan 31 12:45 gra44half.vnsdn
-rw------- 1 mkaukone markau      532 Jan 31 12:45 gra44half.scf0
-rw------- 1 mkaukone markau   830693 Jan 31 12:46 gra44half.output0000

 lapw0.error has contents:
Error in LAPW0


There also seems to be some memory problems with lapw1... But hope to
settle lapw0 first.

Terveisin, Markus

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